2-methylpropyl 3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
2-methylpropyl 3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
2-methylpropyl 3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0212 |
| Compound Name: | 2-methylpropyl 3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 249.31 |
| Molecular Formula: | C14 H19 N O3 |
| Smiles: | CC(C)COC(c1c(C)c2C(CCCc2[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4076 |
| logD: | 2.4076 |
| logSw: | -2.2517 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.442 |
| InChI Key: | KGTQFSRHGCYKDK-UHFFFAOYSA-N |